[3-oxidanyl-6-(phenylcarbonyl)-2-(sulfomethyl)phenyl]methanesulfonic acid

Systemtic Name: [3-oxidanyl-6-(phenylcarbonyl)-2-(sulfomethyl)phenyl]methanesulfonic acid Openeye Name: [6-benzoyl-3-hydroxy-2-(sulfomethyl)phenyl]methanesulfonic acid CAS Name: [6-benzoyl-3-hydroxy-2-(sulfomethyl)phenyl]methanesulfonic acid IUPAC Name: [6-benzoyl-3-hydroxy-2-(sulfomethyl)phenyl]methanesulfonic acid Traditional Name: [6-benzoyl-3-hydroxy-2-(sulfomethyl)phenyl]methanesulfonic acid Formula: C15H14O8S2 MolecularWeight: 386.39686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)O)CS(=O)(=O)O)CS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)O)CS(=O)(=O)O)CS(=O)(=O)O

InChI

InChI=1S/C15H14O8S2/c16-14-7-6-11(15(17)10-4-2-1-3-5-10)12(8-24(18,19)20)13(14)9-25(21,22)23/h1-7,16H,8-9H2,(H,18,19,20)(H,21,22,23)